N-cyclohexyl-2-piperidin-4-ylbenzamide;hydrochloride

C18H27ClN2O — CID 170456891

IUPACN-cyclohexyl-2-piperidin-4-ylbenzamide;hydrochloride
SMILESCl.O=C(NC1CCCCC1)c1ccccc1C1CCNCC1
InChIInChI=1S/C18H26N2O.ClH/c21-18(20-15-6-2-1-3-7-15)17-9-5-4-8-16(17)14-10-12-19-13-11-14;/h4-5,8-9,14-15,19H,1-3,6-7,10-13H2,(H,20,21);1H
InChIKeyBINMFANENQLFGM-UHFFFAOYSA-N
MW322.88 g/mol
LogP3.64
Rot. Bonds3

About N-cyclohexyl-2-piperidin-4-ylbenzamide;hydrochloride

N-cyclohexyl-2-piperidin-4-ylbenzamide;hydrochloride (PubChem CID 170456891) has the molecular formula C18H27ClN2O and a molecular weight of 322.88 g/mol. Its IUPAC name is N-cyclohexyl-2-piperidin-4-ylbenzamide;hydrochloride.

Molecular Properties

Compound NameN-cyclohexyl-2-piperidin-4-ylbenzamide;hydrochloride
PubChem CID170456891
Molecular FormulaC18H27ClN2O
Molecular Weight322.88 g/mol
Exact Mass322.18
IUPAC NameN-cyclohexyl-2-piperidin-4-ylbenzamide;hydrochloride
SMILESCl.O=C(NC1CCCCC1)c1ccccc1C1CCNCC1
InChIInChI=1S/C18H26N2O.ClH/c21-18(20-15-6-2-1-3-7-15)17-9-5-4-8-16(17)14-10-12-19-13-11-14;/h4-5,8-9,14-15,19H,1-3,6-7,10-13H2,(H,20,21);1H
InChIKeyBINMFANENQLFGM-UHFFFAOYSA-N
XLogP3.64
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.88
LogP ≤ 53.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-cyclohexyl-2-fluoro-3-piperidin-4-ylbenzamide
CID 166001097
2-chloro-N-cycloheptylbenzamide;pyrrolidine
CID 143233402
2-ethoxy-N-piperidin-4-ylbenzamide;hydrochloride
CID 119389363
N-cyclopentyl-2-methyl-5-piperidin-4-ylbenzamide;hydrochloride
CID 171361893
N-hexyl-2-piperidin-4-ylbenzamide
CID 170456896
2-chloro-N-cyclopentylbenzamide
CID 669043
N-cyclohexyl-1,2,3,4-tetrahydroquinoxaline-5-carboxamide
CID 104614463
N-cycloheptyl-2-(propan-2-ylamino)benzamide
CID 63107657
ethyl 4-[(2-pyrrolidin-3-ylbenzoyl)amino]piperidine-1-carboxylate
CID 56893622
2-cyclopentylbenzohydrazide
CID 68852694
N-cyclopentyl-3-piperidin-4-yl-4-(trifluoromethyl)benzamide;hydrochloride
CID 171361785
2-(2-ethoxyphenoxy)-N-piperidin-4-ylbenzamide;hydrochloride
CID 119389301

Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-piperidin-4-ylbenzamide;hydrochloride?
The IUPAC name of N-cyclohexyl-2-piperidin-4-ylbenzamide;hydrochloride (CID 170456891) is N-cyclohexyl-2-piperidin-4-ylbenzamide;hydrochloride.
What is the SMILES notation for N-cyclohexyl-2-piperidin-4-ylbenzamide;hydrochloride?
The canonical SMILES for N-cyclohexyl-2-piperidin-4-ylbenzamide;hydrochloride is Cl.O=C(NC1CCCCC1)c1ccccc1C1CCNCC1.
What is the InChIKey of N-cyclohexyl-2-piperidin-4-ylbenzamide;hydrochloride?
The InChIKey is BINMFANENQLFGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26N2O.ClH/c21-18(20-15-6-2-1-3-7-15)17-9-5-4-8-16(17)14-10-12-19-13-11-14;/h4-5,8-9,14-15,19H,1-3,6-7,10-13H2,(H,20,21);1H.
What are the key properties of N-cyclohexyl-2-piperidin-4-ylbenzamide;hydrochloride?
N-cyclohexyl-2-piperidin-4-ylbenzamide;hydrochloride has a molecular weight of 322.88 g/mol, XLogP of 3.64, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-piperidin-4-ylbenzamide;hydrochloride is sourced from PubChem (CID 170456891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).